SCHEMBL590010

SCHEMBL590010

O=C1CSc2ccc(N3C[C@@H](CCCNCc4ccnc5ccccc45)OC3=O)cc2N1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 12/20 0.36
KCNH2 Q12809 2/20 0.34
POLB P06746 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL590824 1.00 GRM2 (0.36) GRM2KCNH2POLB
SCHEMBL590011 1.00 GRM2 (0.36) GRM2KCNH2POLB
SCHEMBL591984 0.95 GRM2 (0.36) GRM2POLB
SCHEMBL590709 0.95 GRM2 (0.36) GRM2POLB
SCHEMBL590379 0.95 GRM2 (0.36) GRM2POLB
SCHEMBL589873 0.91 GRM2 (0.37) GRM2KCNH2
SCHEMBL592282 0.91 GRM2 (0.37) GRM2KCNH2
SCHEMBL589874 0.91 GRM2 (0.37) GRM2KCNH2
SCHEMBL591361 0.89 KCNH2 (0.47) GRM2KCNH2
SCHEMBL590215 0.89 KCNH2 (0.47) GRM2KCNH2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114867-B2 Oxazolidinone antibiotic derivatives ACTELION PHARMACEUTICALS LTD (CH) 2012-02-14 US disclosed
US-20100137290-A1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2010-06-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100137290-A1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES OXA1L, XDH, CCNY GRM2 4516/4885KCNH2 2218/4885POLB 453/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.